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CHEBI:107587 - 4-[[3-[(4-methylanilino)-oxomethyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino]-4-oxobutanoic acid

ChEBI IDCHEBI:107587
ChEBI Name4-[[3-[(4-methylanilino)-oxomethyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino]-4-oxobutanoic acid
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DownloadsMolfile
FormulaC21H24N2O4S
Net Charge0
Average Mass400.500
Monoisotopic Mass400.14568
SMILESCc1ccc(NC(=O)c2c(NC(=O)CCC(=O)O)sc3c2CCCCC3)cc1
InChIInChI=1S/C21H24N2O4S/c1-13-7-9-14(10-8-13)22-20(27)19-15-5-3-2-4-6-16(15)28-21(19)23-17(24)11-12-18(25)26/h7-10H,2-6,11-12H2,1H3,(H,22,27)(H,23,24)(H,25,26)
InChIKeyPCAAPIJWXOJZEZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[[3-[(4-methylanilino)-oxomethyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino]-4-oxobutanoic acid (CHEBI:107587) is a aromatic amide (CHEBI:62733)
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